SCHEMBL7307450

SCHEMBL7307450

Cc1cc(Br)cc(C(=O)OCc2ccccc2)c1N(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 12/20 0.61
MMP9 P14780 11/20 0.61
ADAM17 P78536 7/20 0.61
MMP1 P03956 8/20 0.54
NR3C1 P04150 1/20 0.48
KEAP1 Q14145 3/20 0.45
NFE2L2 Q16236 3/20 0.45
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.43
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5092889 0.81 MMP13 (0.67) MMP13MMP9ADAM17MMP1NR3C1
SCHEMBL7316136 0.80 MMP13 (0.79) MMP13MMP9ADAM17MMP1
SCHEMBL7313797 0.80 MMP13 (0.72) MMP13MMP9ADAM17MMP1
SCHEMBL7316882 0.78 MMP13 (0.63) MMP13MMP9ADAM17MMP1NR3C1
SCHEMBL7310743 0.78 MMP13 (0.94) MMP13MMP9ADAM17MMP1
SCHEMBL7317150 0.78 MMP13 (0.78) MMP13MMP9ADAM17MMP1
SCHEMBL7318672 0.78 MMP13 (0.71) MMP13MMP9ADAM17MMP1
SCHEMBL7323169 0.77 MMP13 (0.74) MMP13MMP9ADAM17MMP1KEAP1
SCHEMBL7325500 0.75 MMP13 (0.87) MMP13MMP9ADAM17MMP1
SCHEMBL6813864 0.73 MMP13 (0.68) MMP13MMP9ADAM17MMP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0938471-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID CO (US) 2001-12-12 EP disclosed
CN-1240429-A Preparation and use of ortho-sulfonamido aryl hydroxamic acids as matrix metalloproteinase and TACE inhibitors AMERICAN CYANAMID CO (US) 2000-01-05 CN disclosed
EP-0938471-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS American Cyanamid Company (US) 1999-09-01 EP disclosed
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed
WO-1998016503-A2 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-04-23 WO disclosed